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canSAR984659
FEATURES
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NAMES
    SMILES
    COc1ccc(NC(=O)[C@@H]2Cc3ccc(OCC(=O)NO)cc3CN2C(=O)CCc2ccccc2)cc1
    InChI
    InChI=1S/C28H29N3O6/c1-36-23-12-9-22(10-13-23)29-28(34)25-16-20-8-11-24(37-18-26(32)30-35)15-21(20)17-31(25)27(33)14-7-19-5-3-2-4-6-19/h2-6,8-13,15,25,35H,7,14,16-18H2,1H3,(H,29,34)(H,30,32)/t25-/m0/s1
    MOLECULAR FORMULA
    C28H29N3O6
    CROSS REFERENCES
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    canSAR984659

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 503.21
    AlogP 3.10
    HBond donors 3
    HBond acceptors 9
    Atoms 66
    Contains toxicophore Yes
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR984659.